AG003MIB

58832-36-3 | 2-Bromofuran-4-carboxylic acid

AG003MIB

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CAS Number	58832-36-3
Catalog Number	AG003MIB(AGN-PC-00M3MO)
Chemical Name	2-Bromofuran-4-carboxylic acid
IUPAC Name	5-bromofuran-3-carboxylic acid
InChI	InChI=1S/C5H3BrO3/c6-4-1-3(2-9-4)5(7)8/h1-2H,(H,7,8)
InChI Key	XYBPFWUNJQTZCM-UHFFFAOYSA-N
MDL Number	MFCD08669547
Molecular Formula	C5H3BrO3
Molecular Weight	190.9795
SMILES	O=C(C1=COC(Br)=C1)O
Synonyms	58832-36-3, 5-bromo-3-furancarboxylic acid, 5-bromofuran-3-carboxylic acid, 2-BROMOFURAN-4-CARBOXYLIC ACID, 5-bromo-3-furoic acid, 2-BROMOFURAN-4-CARBOXYLICACID, 3-Furancarboxylic acid, 5-bromo-, SCHEMBL363660, 5-Bromo-3-furancarboxylicAcid, AC1Q741J, 2-bromo-furan-4-carboxylic acid, CTK1G9027, KS-00000CUH, 5-Bromo-furan-3-carboxylic acid, DTXSID10537216, 5-bromanylfuran-3-carboxylic acid, XYBPFWUNJQTZCM-UHFFFAOYSA-N, ZINC8700555, 5491AJ, MFCD08669547, AKOS000126905, AB45895, CS-W023154, RP25030, TRA0066798, NCGC00341448-01, AS-31791, QC-10358, SC-21648, SY021737, 2-bromofuran-4-carboxylic acid, AldrichCPR, AB0052007, TC-307881, FT-0601828, EN300-31285, C-1915, AB01156614-03, MFCD08669547 (97+%), A832037, J-508519, Z255102436, C5H3BrO3, 2106-05-0,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.927g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.98g/mol
Monoisotopic Mass	189.927g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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